3,4-dimethyl-N-[1-(2-oxidanylidene-2-phenylazanyl-ethyl)piperidin-1-ium-4-yl]benzamide

Systemtic Name: 3,4-dimethyl-N-[1-(2-oxidanylidene-2-phenylazanyl-ethyl)piperidin-1-ium-4-yl]benzamide Openeye Name: N-[1-(2-anilino-2-oxo-ethyl)piperidin-1-ium-4-yl]-3,4-dimethyl-benzamide CAS Name: N-[1-(2-anilino-2-oxoethyl)-4-piperidin-1-iumyl]-3,4-dimethylbenzamide IUPAC Name: N-[1-(2-anilino-2-oxoethyl)piperidin-1-ium-4-yl]-3,4-dimethylbenzamide Traditional Name: N-[1-(2-anilino-2-keto-ethyl)piperidin-1-ium-4-yl]-3,4-dimethyl-benzamide Formula: C22H28N3O2+ MolecularWeight: 366.47662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2CC[NH+](CC2)CC(=O)NC3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2CC[NH+](CC2)CC(=O)NC3=CC=CC=C3)C

InChI

InChI=1S/C22H27N3O2/c1-16-8-9-18(14-17(16)2)22(27)24-20-10-12-25(13-11-20)15-21(26)23-19-6-4-3-5-7-19/h3-9,14,20H,10-13,15H2,1-2H3,(H,23,26)(H,24,27)/p+1